(5-ethanoyl-2-methoxy-phenyl)methyl 3-methylsulfonylbenzoate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl 3-methylsulfonylbenzoate Openeye Name: (5-acetyl-2-methoxy-phenyl)methyl 3-methylsulfonylbenzoate CAS Name: 3-methylsulfonylbenzoic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl 3-methylsulfonylbenzoate Traditional Name: 3-mesylbenzoic acid (5-acetyl-2-methoxy-benzyl) ester Formula: C18H18O6S MolecularWeight: 362.39692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)COC(=O)C2=CC(=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C18H18O6S/c1-12(19)13-7-8-17(23-2)15(9-13)11-24-18(20)14-5-4-6-16(10-14)25(3,21)22/h4-10H,11H2,1-3H3